2,2-dimethyl-4-[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]-3-sulfanylidene-piperidine-1-carboxylic acid

Systemtic Name: 2,2-dimethyl-4-[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]-3-sulfanylidene-piperidine-1-carboxylic acid Openeye Name: 4-(1-tert-butoxycarbonylpyrrolidin-2-yl)-2,2-dimethyl-3-thioxo-piperidine-1-carboxylic acid CAS Name: 2,2-dimethyl-4-[1-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-pyrrolidinyl]-3-sulfanylidene-1-piperidinecarboxylic acid IUPAC Name: 2,2-dimethyl-4-[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]-3-sulfanylidenepiperidine-1-carboxylic acid Traditional Name: 4-(1-tert-butoxycarbonylpyrrolidin-2-yl)-2,2-dimethyl-3-thioxo-piperidine-1-carboxylic acid Formula: C17H28N2O4S MolecularWeight: 356.48022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=S)C(CCN1C(=O)O)C2CCCN2C(=O)OC(C)(C)C)C

Isomeric SMILES

CC1(C(=S)C(CCN1C(=O)O)C2CCCN2C(=O)OC(C)(C)C)C

InChI

InChI=1S/C17H28N2O4S/c1-16(2,3)23-15(22)18-9-6-7-12(18)11-8-10-19(14(20)21)17(4,5)13(11)24/h11-12H,6-10H2,1-5H3,(H,20,21)